Information card for entry 7004734

Structure parameters

• Common name: bis((mu!2$-Oxo)-(2,2'-bipyridyl-N,N')-fluoro-oxo-vanadium(v))
• Chemical name: bis((mu!2$-Oxo)-(2,2'-bipyridyl-N,N')-fluoro-oxo-vanadium(v))
• Formula: C20 H16 F2 N4 O4 V2
• Calculated formula: C20 H16 F2 N4 O4 V2
• SMILES: c1[n]2c(ccc1)c1cccc[n]1[V]12(F)(=O)O[V]2(F)([n]3ccccc3c3cccc[n]23)(=O)O1
• Title of publication: Synthesis, chemistry and structures of complexes of the dioxovanadium(v) halides VO2F and VO2Cl
• Authors of publication: Davis, Martin F.; Jura, Marek; Leung, Alethea; Levason, William; Littlefield, Benjamin; Reid, Gillian; Webster, Michael
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 44
• Pages of publication: 6265 - 6273
• a: 6.3764 ± 0.0015 Å
• b: 15.828 ± 0.003 Å
• c: 10.287 ± 0.002 Å
• α: 90°
• β: 107.869 ± 0.01°
• γ: 90°
• Cell volume: 988.1 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No